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MCULE-5100492954-1
Structure
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
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1
MCULE-2044524424-0
- Component type: Main
-
1
MCULE-8295936189-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5100492954-1.sdf |
| SMILES | MCULE-5100492954-1.smiles |
| Standard InChI | MCULE-5100492954-1.inchi |
| InChIKey | MCULE-5100492954-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-24170720 | InterBioScreen | Screening Compounds | 92 | As is | 130 mg |
| P-4909794 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 15 mg |
| P-34767045 | Crea-Chim | HTS compounds | 90 | Main component | unavailable |
| P-24076344 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-453963458 | Specs | Screening Compounds | 90 | Main component | 8 mg |
| P-22574876 | TimTec | ActiMol 3 Week | 90 | Main component | in stock |
| P-33194224 | TimTec | ActiMol 1 Week - Stock | 90 | Main component | 5 mg |
| P-2345176 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 89 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 363.215 |
| logP | 3.6601 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 124.78 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 92.1432 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 12 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
